%chk=000004528.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004528

0 1
 N  -0.4099000      -2.247400      0.1512000    
 N   -4.009200     -8.6199999E-02   1.093400    
 C   0.4637000     -0.2967000      -1.121800    
 C   0.2444000      -1.827800      -1.095300    
 C  -0.7660000      0.4714000     -0.6672000    
 C   -1.766200      -1.681900      0.2307000    
 C   -1.808600     -0.1877000      8.8000000E-03
 C    1.730000      9.2900001E-02 -0.3667000    
 C   -2.933000      0.5409000      0.4226000    
 C  -0.8620000       1.851900     -0.9042000    
 C  -0.4573000      -3.705600      0.2495000    
 C   -3.014600       1.912600      0.1851000    
 C    1.662200      0.3791000      0.9931000    
 C    2.943800      0.1598000      -1.043200    
 C   -1.980100       2.567400     -0.4778000    
 C    2.820400      0.7360000       1.683700    
 C    4.102100      0.5165000     -0.3526000    
 C    4.040300      0.8046000       1.010800    
 H   0.6128000     -2.5300000E-02  -2.177700    
 H  -0.3752000      -2.120400      -1.955200    
 H    1.208100      -2.340000      -1.214400    
 H   -2.138300      -1.907700       1.236600    
 H   -2.432000      -2.156100     -0.5027000    
 H  -6.3900001E-02   2.376900      -1.423300    
 H  -0.9213000      -4.013200       1.193100    
 H   0.5557000      -4.123100      0.2478000    
 H   -1.018300      -4.159300     -0.5756000    
 H   -3.881600       2.483200      0.5084000    
 H   0.7325000      0.3202000       1.550500    
 H    3.004900     -6.4499997E-02  -2.104500    
 H   -2.044500       3.635300     -0.6648000    
 H   -4.812300      0.4659000       1.366000    
 H   -4.047300      -1.089300       1.201800    
 H    2.773400      0.9568000       2.746000    
 H    5.052100      0.5692000     -0.8761000    
 H    4.942200       1.081300       1.548800    


%chk=000004528-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000004528

0 1
N -0.408842 -2.199311 0.138353
N -4.081415 -0.083951 0.997501
C 0.449546 -0.262710 -1.163873
C 0.180170 -1.792193 -1.151517
C -0.792385 0.502430 -0.694912
C -1.761936 -1.645893 0.318544
C -1.841891 -0.163928 -0.017690
C 1.717498 0.092024 -0.378837
C -3.017137 0.564347 0.356027
C -0.889139 1.891376 -0.965417
C -0.354202 -3.648526 0.387307
C -3.099399 1.955723 0.080773
C 1.722005 0.148354 1.038762
C 2.932432 0.331256 -1.070926
C -2.035085 2.610790 -0.570866
C 2.913599 0.429102 1.743109
C 4.126484 0.615349 -0.369190
C 4.120953 0.663957 1.043553
H 0.634661 0.018024 -2.221096
H -0.491958 -2.051967 -2.011184
H 1.130286 -2.337528 -1.293182
H -2.052176 -1.804393 1.379693
H -2.517548 -2.206030 -0.306070
H -0.063135 2.398661 -1.476323
H -0.738016 -3.866915 1.400823
H 0.693143 -3.993833 0.337964
H -0.955112 -4.248520 -0.343637
H -3.996741 2.514194 0.375636
H 0.788121 -0.033104 1.579210
H 2.942696 0.298656 -2.168522
H -2.107973 3.684695 -0.777170
H -4.906825 0.441876 1.268447
H -4.093295 -1.089298 1.130611
H 2.901310 0.468456 2.838681
H 5.054706 0.802222 -0.921717
H 5.043600 0.886308 1.591935


